IFLAB-ZINC04376758 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -0.3780 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 0.7380 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -1.7660 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -2.0030 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -3.2740 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -4.3490 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -5.6620 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -6.2170 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -5.3000 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -4.0870 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.7680 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -5.5910 -0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -7.4010 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -7.8160 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -8.0000 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -8.3810 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 -8.5780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -8.3920 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -8.0170 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -8.9490 0.0200 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 2.0340 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6600 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 2.8450 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -1.1700 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 -3.4590 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -7.7910 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -7.7990 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -7.8470 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -8.5250 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -8.5450 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -7.8760 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 M END